Glycoside
GD137550
Name:
{[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}-λâµ-phosphanetris(olate)Formula:
C10H13O7N5PSmiles:
[NH-]c1[nH+]cnc2c1[N-][CH]N2C1OC(COP(=O)([O-])O)C(O)C1OAglycone:
COP(=O)([O-])O.[NH-]c1[nH+]cnc2c1[N-]CN2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.22 | Num_heavy_atoms: | 23 |
| TPSA: | 187.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD00397
Formula: CH4O4P
Smiles:
COP(=O)([O-])O| HBA: | 4 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 1 |
| MolWt: | 111.01 | Num_heavy_atoms: | 6 |
| TPSA: | 69.59 | NumAromaticRings: | 0 |
AD55567
Formula: C5H6N5
Smiles:
[NH-]c1[nH+]cnc2c1[N-]CN2| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 0 |
| MolWt: | 136.14 | Num_heavy_atoms: | 10 |
| TPSA: | 76.96 | NumAromaticRings: | 1 |
